Interaction Scheme
Molecule
Methylammonium
Host
o-(Me)2-1.1.1
c = 2000.0 µM
Binding Properties
| 𝜈 | Molecule 1 : 1 Host | ||
| Ka = | 290.0 | ± 10.0 | M-1 |
| Kd = | |||
| logKa = | |||
| T | 25.0 °C | ||
| Energy | kJ mol-1 | kcal mol-1 | |||
|---|---|---|---|---|---|
| ΔG | = | -14.06 | ± 0.09 | -3.36 | ± 0.02 |
These are the specifications of the determination of the experimental results.
| Detection Method: | Direct | ||
| Assay Type: | Direct Binding Assay | ||
| Technique: | Nuclear Magnetic Resonance | ||
Detailed information about the solvation.
| Solvent System | Single Solvent |
| Solvent | Acetonitrile-d3 |
Please find here information about the dataset this interaction is part of.
| Citation: |
O. Shyshov, M. von Delius, X. Wang, C. Jäger, M. Hanževački, SupraBank 2024, Ammonium Complexes of Orthoester Cryptands Are Inherently Dynamic and Adaptive (dataset). https://doi.org/10.34804/supra.20210928237 |
| Link: | https://doi.org/10.34804/supra.20210928237 |
| Export: | BibTex | RIS | EndNote |
Please find here information about the scholarly article describing the results derived from that data.
| Citation: |
X. Wang, O. Shyshov, M. Hanževački, C. M. Jäger, M. von Delius, J. Am. Chem. Soc. 2019, 141, 8868–8876. |
| Link: | https://doi.org/10.1021/jacs.9b01350 |
| Export: | BibTex | RIS | EndNote | |
Binding Isotherm Simulations
The plot depicts the binding isotherm simulation of a 1:1 interaction of Methylammonium (0.06896551724137931 M) and o-(Me)2-1.1.1 (0 — 0.13793103448275862 M).
Please sign in: customize the simulation by signing in to the SupraBank.
